SCHEMBL7355571

SCHEMBL7355571

N[C@H](CC1CCCCC1)[C@H](O)C(=O)NC(CO)C(=O)OCc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 10/20 0.46
METAP1 P53582 7/20 0.46
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
POLB P06746 1/20 0.40
CTSS P25774 1/20 0.39
EPHX1 P07099 2/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7356020 0.89 METAP2 (0.46) METAP2METAP1ALDH1A1MEN1KMT2A
SCHEMBL7353742 0.84 METAP2 (0.47) METAP2METAP1CTSS
SCHEMBL7353713 0.84 METAP2 (0.47) METAP2METAP1
SCHEMBL7355544 0.77 METAP2 (0.58) METAP2METAP1
SCHEMBL6484036 0.76 METAP2 (0.64) METAP2METAP1ALDH1A1MEN1KMT2A
SCHEMBL7360924 0.76 METAP2 (0.49) METAP2METAP1CTSSEPHX1
Hydrochloric Acid SCHEMBL7356207 0.76 METAP2 (0.57) METAP2METAP1
SCHEMBL7352302 0.75 METAP2 (0.60) METAP2METAP1CTSS
SCHEMBL16730492 0.74 METAP2 (0.51) METAP2METAP1ALDH1A1EPHX1
SCHEMBL7353581 0.73 METAP2 (0.54) METAP2METAP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6242494-B1 ANGIOGENESIS INHIBITORS, ANTITUMOR AGENTS, DIABETIC RETINOPATHY, AND ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES 2001-06-05 US claimed